2-Thiophenecarboxylicacid, tetrahydro-5-oxo-


Chemical Name: 2-Thiophenecarboxylicacid, tetrahydro-5-oxo-
CAS Number: 222046-90-4
Product Number: AG007P7V(AGN-PC-00PESA)
Synonyms:
MDL No:
Molecular Formula: C5H6O3S
Molecular Weight: 146.1643

Identification/Properties


Computed Properties
Molecular Weight:
146.16g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
146.004g/mol
Monoisotopic Mass:
146.004g/mol
Topological Polar Surface Area:
79.7A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
154
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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